[4-(5-hexoxypyrimidin-2-yl)phenyl] 3-ethoxypropanoate

Systemtic Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-ethoxypropanoate Openeye Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-ethoxypropanoate CAS Name: 3-ethoxypropanoic acid [4-(5-hexoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-hexoxypyrimidin-2-yl)phenyl] 3-ethoxypropanoate Traditional Name: 3-ethoxypropionic acid [4-(5-hexoxypyrimidin-2-yl)phenyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCC

Isomeric SMILES

CCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)CCOCC

InChI

InChI=1S/C21H28N2O4/c1-3-5-6-7-13-26-19-15-22-21(23-16-19)17-8-10-18(11-9-17)27-20(24)12-14-25-4-2/h8-11,15-16H,3-7,12-14H2,1-2H3